3-bromanyl-N-(2-oxidanylpropylcarbamothioyl)-4-phenethyloxy-benzamide

Systemtic Name: 3-bromanyl-N-(2-oxidanylpropylcarbamothioyl)-4-phenethyloxy-benzamide Openeye Name: 3-bromo-N-(2-hydroxypropylcarbamothioyl)-4-phenethyloxy-benzamide CAS Name: 3-bromo-N-[(2-hydroxypropylamino)-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: 3-bromo-N-(2-hydroxypropylcarbamothioyl)-4-phenethyloxybenzamide Traditional Name: 3-bromo-N-(2-hydroxypropylthiocarbamoyl)-4-phenethyloxy-benzamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=S)NC(=O)C1=CC(=C(C=C1)OCCC2=CC=CC=C2)Br)O

Isomeric SMILES

CC(CNC(=S)NC(=O)C1=CC(=C(C=C1)OCCC2=CC=CC=C2)Br)O

InChI

InChI=1S/C19H21BrN2O3S/c1-13(23)12-21-19(26)22-18(24)15-7-8-17(16(20)11-15)25-10-9-14-5-3-2-4-6-14/h2-8,11,13,23H,9-10,12H2,1H3,(H2,21,22,24,26)